Compound Identification
SMILES
NC(=O)C1=CC=C(C=C1)C1=NC(NC2=CC=CC(=C2)C(F)(F)F)=NC(OCC(F)(F)F)=N1
InChIKey
InChIKey=CXGUGJIFCUATDJ-UHFFFAOYSA-N
Formula
C19H13F6N5O2
Mass
457.336
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Benzamides Benzoyl derivatives Aniline and substituted anilines Alkoxy-S-triazines Aminotriazines Alkyl aryl ethers Heteroaromatic compounds Primary carboxylic acid amides Amino acids and derivatives Secondary amines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Benzamide - Benzoic acid or derivatives - Alkoxy-s-triazine - Aniline or substituted anilines - Benzoyl - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - 1,3,5-triazine - Triazine - Heteroaromatic compound - Amino acid or derivatives - Primary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Ether - Organooxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available